N-[(4-pyrrolidin-1-ylcarbonylphenyl)carbamothioyl]hexanamide

Systemtic Name: N-[(4-pyrrolidin-1-ylcarbonylphenyl)carbamothioyl]hexanamide Openeye Name: N-[[4-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]hexanamide CAS Name: N-[[4-[oxo(1-pyrrolidinyl)methyl]anilino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[4-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]hexanamide Traditional Name: N-[[4-(pyrrolidine-1-carbonyl)phenyl]thiocarbamoyl]hexanamide Formula: C18H25N3O2S MolecularWeight: 347.475

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=CC=C(C=C1)C(=O)N2CCCC2

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=CC=C(C=C1)C(=O)N2CCCC2

InChI

InChI=1S/C18H25N3O2S/c1-2-3-4-7-16(22)20-18(24)19-15-10-8-14(9-11-15)17(23)21-12-5-6-13-21/h8-11H,2-7,12-13H2,1H3,(H2,19,20,22,24)